Compound Detail
CHEMBL4448264
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O=c1oc2ccccc2cc1-c1nn(C(Nc2ccc(Oc3ccc(NC(c4cccc(Br)c4)n4nc(-c5cc6ccccc6oc5=O)oc4=S)cc3)cc2)c2cccc(Br)c2)c(=S)o1
Basic Information
| ChEMBL ID | CHEMBL4448264 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | YKUVPZUHOIVVDU-UHFFFAOYSA-N |
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
1026.7
MW (Da)
Drug Information
| Molecule Type | Unknown |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 7.4
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Unchecked CHEMBL612545 | IC50 | 7.4 | 7.28 | 40.0 | 2 |
| Alpha glucosidase CHEMBL3833502 | IC50 | 7.16 | 7.16 | 70.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Unchecked | IC50 | = | 40.0 | nM | 7.4 | Inhibition of rat intestinal maltase-glucoamylase using p-nitrophenyl alpha-D-gl... | 31112894 |
| Alpha glucosidase | IC50 | = | 70.0 | nM | 7.16 | Inhibition of alpha-glucosidase (unknown origin) using p-nitro phenyl glucopyran... | 31112894 |
| Unchecked | IC50 | = | 70.0 | nM | 7.16 | Inhibition of alpha-glucosidase (unknown origin) | 32008883 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 31112894 | 10.1016/j.ejmech.2019.04.025 | Alpha glucosidase | 1 |
| 31112894 | 10.1016/j.ejmech.2019.04.025 | Unchecked | 1 |
| 32008883 | 10.1016/j.bmc.2019.115263 | Unchecked | 1 |
Data from ChEMBL 36 via Core Engine